Geometry & MOs

Info

ID:	189436
PubChem CID:	77855264
Reduced:	N2O7C15H22 (1)
Stoich.:	A2B7C15D22 (1)
Weight, g/mol:	294.103814
ΔH_f, kcal/mol:	-301.12
Dipole, Da:	6.25
IP(EA), eV:	-10.08(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(2-methoxy-4-methylsulfinylphenyl)ethenyl]diazinan-3-one

Drug info:

PubChemData

Smile

CC(=C)C(C(=O)O)N1C(C(C1=O)NC(=O)OC(C)(C)C)OC(=O)C

DOS

IR

Vibrations